butyl 3-methyl-5-(phenoxycarbonylamino)-1,2-thiazole-4-carboxylate hydrobromide

Systemtic Name: butyl 3-methyl-5-(phenoxycarbonylamino)-1,2-thiazole-4-carboxylate hydrobromide Openeye Name: butyl 3-methyl-5-(phenoxycarbonylamino)isothiazole-4-carboxylate hydrobromide CAS Name: 3-methyl-5-[[oxo(phenoxy)methyl]amino]-4-isothiazolecarboxylic acid butyl ester hydrobromide IUPAC Name: butyl 3-methyl-5-(phenoxycarbonylamino)-1,2-thiazole-4-carboxylate hydrobromide Traditional Name: 5-(carbophenoxyamino)-3-methyl-isothiazole-4-carboxylic acid butyl ester hydrobromide Formula: C16H19BrN2O4S MolecularWeight: 415.30206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(SN=C1C)NC(=O)OC2=CC=CC=C2.Br

Isomeric SMILES

CCCCOC(=O)C1=C(SN=C1C)NC(=O)OC2=CC=CC=C2.Br

InChI

InChI=1S/C16H18N2O4S.BrH/c1-3-4-10-21-15(19)13-11(2)18-23-14(13)17-16(20)22-12-8-6-5-7-9-12;/h5-9H,3-4,10H2,1-2H3,(H,17,20);1H